3-PHENYLPROPIONITRILE


Catalog No:   FT-0649505

CAS No:   645-59-0

  • Molecular Formula:  131.17
  • Formula Weight: C9H9N
  • Inchl Key: ACRWYXSKEHUQDB-UHFFFAOYSA-N
  • Inchl: InChI=1S/C9H9N/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H,4,7H2

Assay Pack Price Stock Action
98% 1g N/A N/A
98% 5g N/A N/A
98% Bulk Quantity N/A N/A
Symbol: GHS06
CAS: 645-59-0
Flash_Point: >230 °F
Product_Name: 3-phenylpropionitrile
Bolling_Point: 113 °C9 mm Hg(lit.)
FW: 131.17400
Melting_Point: −2-−1 °C(lit.)
MF: C9H9N
Density: 1.001 g/mL at 25 °C(lit.)
Refractive_Index: n20/D 1.521(lit.)
Flash_Point: >230 °F
LogP: 2.14278
Bolling_Point: 113 °C9 mm Hg(lit.)
PSA: 23.79000
Molecular_Structure: ['1 . Molar refractive index 4034 ', '2 . Molar volume 1321 ', '3 . Parachor (902K)3319 ', '4 . Surface tension 398 ', '5 . Polarizability 1599']
Computational_Chemistry: ['1. XlogP :N/A ', '2. Hydrogen Bond Donor Count :0 ', '3. Hydrogen Bond Acceptor Count :1 ', '4. Rotatable Bond Count :2 ', '5. Isotope Atom Count :N/A ', '6. TPSA 238 ', '7. Heavy Atom Count :10 ', '8. Topological Polar Surface Area :0 ', '9. Complexity :125 ', '10. Isotope Atom Count :0 ', '11. Defined Atom Stereocenter Count :0 ', '12. Undefined Atom Stereocenter Count :0 ', '13. Defined Bond Stereocenter Count :0 ', '14. Undefined Bond Stereocenter Count :0 ', '15. Covalently-Bonded Unit Count :1']
Melting_Point: −2-−1 °C(lit.)
MF: C9H9N
Exact_Mass: 131.07300
FW: 131.17400
Density: 1.001 g/mL at 25 °C(lit.)
More_Info: ['1 . Appearance 有毒Liquid 。 ', '2 . Density(g/mL,25/4℃)1008 ', '3 . Relative vapor density(g/mL,Atmosphere =1)Unknow ', '4 . Melting point(ºC)-1 ', '5 . Boiling point(ºC,Atmospheric pressure)261,141ºC(3333pa) ', '6 . Boiling point(ºC,52kPa)Unknow ', '7 . Refractive index(n28D)1521 ', '8 . Flash point(ºC) >110 ', '9 . Specific rotation(º)Unknow ', '10 . Spontaneous ignition point or ignition temperature(ºC)Unknow ', '11 . Vapor pressure(kPa,25ºC)Unknow ', '12 . Saturated vapor pressure(kPa,60ºC)Unknow ', '13 . Combustion heat(KJ/mol)Unknow ', '14 . Critical temperature(ºC)Unknow ', '15 . Critical pressure(KPa)Unknow ', '16 . Oil-water(Octanol /Water )Logarithmic Value of Distribution Coefficient Unknow ', '17 . Upper limit of explosion(%,V/V)Unknow ', '18 . Lower limit of explosion(%,V/V)Unknow ', '19 . Solubility Soluble in Ethanol Ethyl ether ,微Soluble in 氯仿。']
Symbol: GHS06
RIDADR: UN 3276 6.1/PG 3
HS_Code: 2926909090
Packing_Group: II
Hazard_Class: 6.1
Risk_Statements(EU): R25
WGK_Germany: 3
Personal_Protective_Equipment: Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter
RTECS: MW5604750
Hazard_Codes: T:Toxic;
Warning_Statement: P261-P280-P301 + P310-P311
Safety_Statements: H301 + H311 + H331

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